0310-0158 Screening compound: 2-[(6-oxo-6H-anthra[1,9-cd]isoxazol-5-yl)amino]ethyl acetate

0310-0158 Screening compound: 2-[(6-oxo-6H-anthra[1,9-cd]isoxazol-5-yl)amino]ethyl acetate
0310-0158 Screening compound: 2-[(6-oxo-6H-anthra[1,9-cd]isoxazol-5-yl)amino]ethyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0310-0158
2-[(6-oxo-6H-anthra[1,9-cd]isoxazol-5-yl)amino]ethyl acetate

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

0310-0158

Molecular Formula

C18H14N2O4 (C18 H14 N2 O4)

Compound Name

2-[(6-oxo-6H-anthra[1,9-cd]isoxazol-5-yl)amino]ethyl acetate

IUPAC name

2-({8-oxo-15-oxa-14-azatetracyclo[7.6.1.0^{27}.0^{1316}]hexadeca-1(16)2(7)3591113-heptaen-10-yl}amino)ethyl acetate

SMILES

CC(OCCNc(ccc1noc(-c2c3cccc2)c11)c1C3=O)=O

InChI

InChI=1S/C18H14N2O4/c1-10(21)23-9-8-19-13-6-7-14-16-15(13)17(22)11-4-2-3-5-12(11)18(16)24-20-14/h2-7,19H,8-9H2,1H3

InChI Key

YPIUMTPSSBKZKH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00992540

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

322.32

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.580

Distribution Coefficient, logD

3.580

Water Solubility, LogSw

-4.27

Polar Surface Area

65.210

Acid Dissociation Constant (pKa)

20.02

Base Dissociation Constant (pKb)

-0.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

0310-0158 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 0310-0158 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0310-0158?
Check Price and Availability of 0310-0158, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 0310-0158 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0310-0158
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0310-0158
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 0310-0158 available by request